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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'IgA-specific serine endopeptidase autotransporter' and Ligand = 'BDBM50016725'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
IgA-specific serine endopeptidase autotransporter


(Neisseria gonorrhoeae)
BDBM50016725
PNG
(2-[(1-{2-[(1-Acetyl-pyrrolidine-2-carbonyl)-amino]...)
Show SMILES CC(=O)N1CCC[C@@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C18H28N4O8/c1-10(25)21-6-2-4-13(21)15(26)19-11(8-23)17(28)22-7-3-5-14(22)16(27)20-12(9-24)18(29)30/h11-14,23-24H,2-9H2,1H3,(H,19,26)(H,20,27)(H,29,30)/t11-,12-,13+,14+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6.75E+5n/an/an/an/an/an/a



University Hospital

Curated by ChEMBL


Assay Description
Inhibitory concentration against type 1 IgA1 proteinases secreted by Neisseria gonorrhoeae


J Med Chem 32: 2407-11 (1989)


BindingDB Entry DOI: 10.7270/Q2R210B0
More data for this
Ligand-Target Pair